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Methyl 13,14-Epoxy-15-hydroxy-7-labden-17-oate
SpectraBase Compound ID 3oVRGtXyG1q
InChI InChI=1S/C21H34O4/c1-19(2)10-6-11-20(3)15(9-12-21(4)17(13-22)25-21)14(18(23)24-5)7-8-16(19)20/h7,15-17,22H,6,8-13H2,1-5H3/t15-,16?,17?,20+,21?/m0/s1
InChIKey MPXFVIKHWDVIAP-PJVUKPMOSA-N
Mol Weight 350.5 g/mol
Molecular Formula C21H34O4
Exact Mass 350.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ENBc3v7u2gK
Name Methyl 13,14-Epoxy-15-hydroxy-7-labden-17-oate
Alternate Name(s) Methyl (1R,4aS,8aS)-1-{2-[3-(hydroxymethyl)-2-methyloxiran-2-yl]ethyl}-5,5,8a-trimethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalene-2-carboxylate
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Formula C21H34O4
InChI InChI=1S/C21H34O4/c1-19(2)10-6-11-20(3)15(9-12-21(4)17(13-22)25-21)14(18(23)24-5)7-8-16(19)20/h7,15-17,22H,6,8-13H2,1-5H3/t15-,16?,17?,20+,21?/m0/s1
InChIKey MPXFVIKHWDVIAP-PJVUKPMOSA-N
Molecular Weight 350.499 g/mol
SMILES OCC1OC1(CC[C@@]1([C@@]2(C(C(C)(C)CCC2)CC=C1C(=O)OC)C)[H])C
SPLASH splash10-0bt9-9610000000-bc03ad56f51b0caea901
Source of Spectrum F-50-11003-12
Wiley ID 789291